{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(2-phenylquinolin-4-yl)methanone
Chemical Structure Depiction of
{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(2-phenylquinolin-4-yl)methanone
{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(2-phenylquinolin-4-yl)methanone
Compound characteristics
| Compound ID: | 4676-0954 |
| Compound Name: | {4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}(2-phenylquinolin-4-yl)methanone |
| Molecular Weight: | 469.99 |
| Molecular Formula: | C27 H20 Cl N3 O S |
| Smiles: | Cc1c(c(C)n(C(c2cc(c3ccccc3)nc3ccccc23)=O)n1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.695 |
| logD: | 6.6949 |
| logSw: | -6.2861 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.64 |
| InChI Key: | FBBMOWHJCMAEPK-UHFFFAOYSA-N |